2-[4-[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[4-(p-tolyl)-2-thioxo-thiazol-3-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[4-(4-methylphenyl)-2-sulfanylidene-3-thiazolyl]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[4-(p-tolyl)-2-thioxo-4-thiazolin-3-yl]acetyl]piperazino]sulfonylbenzonitrile Formula: C23H22N4O3S3 MolecularWeight: 498.64078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=S)N2CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=S)N2CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H22N4O3S3/c1-17-6-8-18(9-7-17)20-16-32-23(31)27(20)15-22(28)25-10-12-26(13-11-25)33(29,30)21-5-3-2-4-19(21)14-24/h2-9,16H,10-13,15H2,1H3